(E)-4-(3-benzamido-4-oxidanylidene-azetidin-2-yl)oxy-2-diazonio-1-(diphenylmethyl)oxy-3-oxidanylidene-but-1-en-1-olate

Systemtic Name: (E)-4-(3-benzamido-4-oxidanylidene-azetidin-2-yl)oxy-2-diazonio-1-(diphenylmethyl)oxy-3-oxidanylidene-but-1-en-1-olate Openeye Name: (E)-4-(3-benzamido-4-oxo-azetidin-2-yl)oxy-1-benzhydryloxy-2-diazonio-3-oxo-but-1-en-1-olate CAS Name: (E)-4-[(3-benzamido-4-oxo-2-azetidinyl)oxy]-2-diazonio-1-(diphenylmethyl)oxy-3-oxo-1-buten-1-olate IUPAC Name: (E)-4-(3-benzamido-4-oxoazetidin-2-yl)oxy-1-benzhydryloxy-2-diazonio-3-oxobut-1-en-1-olate Traditional Name: (E)-4-(3-benzamido-4-keto-azetidin-2-yl)oxy-1-benzhydryloxy-2-diazonio-3-keto-but-1-en-1-olate Formula: C27H22N4O6 MolecularWeight: 498.48678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=C(C(=O)COC3C(C(=O)N3)NC(=O)C4=CC=CC=C4)[N+]#N)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)O/C(=C(\C(=O)COC3C(C(=O)N3)NC(=O)C4=CC=CC=C4)/[N+]#N)/[O-]

InChI

InChI=1S/C27H22N4O6/c28-31-21(27(35)37-23(17-10-4-1-5-11-17)18-12-6-2-7-13-18)20(32)16-36-26-22(25(34)30-26)29-24(33)19-14-8-3-9-15-19/h1-15,22-23,26H,16H2,(H2-,29,30,32,33,34,35)